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SMILES: Fc1ccc(C(=O)NOCCCNCCOCCOCCOCCOCCOCCNc2ccc3C(=O)N(C4CCC(=O)NC4=O)C(=O)c3c2)c(Nc2ccc(I)cc2F)c1F

InChI Key:

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50556786   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Dual specificity mitogen-activated protein kinase kinase 2


(Homo sapiens (Human))
BDBM50556786
PNG
(CHEMBL4744750)
Show SMILES Fc1ccc(C(=O)NOCCCNCCOCCOCCOCCOCCOCCNc2ccc3C(=O)N(C4CCC(=O)NC4=O)C(=O)c3c2)c(Nc2ccc(I)cc2F)c1F
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/a 2.40E+3n/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01609
BindingDB Entry DOI: 10.7270/Q2QR51SB
More data for this
Ligand-Target Pair
Dual specificity mitogen-activated protein kinase kinase 1


(Homo sapiens (Human))
BDBM50556786
PNG
(CHEMBL4744750)
Show SMILES Fc1ccc(C(=O)NOCCCNCCOCCOCCOCCOCCOCCNc2ccc3C(=O)N(C4CCC(=O)NC4=O)C(=O)c3c2)c(Nc2ccc(I)cc2F)c1F
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/a 660n/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01609
BindingDB Entry DOI: 10.7270/Q2QR51SB
More data for this
Ligand-Target Pair